Publisher's Synopsis
Excerpt from The Evaluation of Two and Three-Center Integrals Arising in Calculations on Molecular Structure
The expression of the solutions of Schrodinger's equation for the electronic configuration of a molecule as a linear combination of given atomic orbital functions transforms Schrodinger's equation into a matrix equation. The solution of this matrix equation involves the evaluation of certain three and six-dimensional integrals referred to as one and two-electron integrals, respectively; The domains of integration of the integrals are all of Euclidean three and six space. Some of the general techniques for evaluating these integrals involve integrating over certain of the variables, transforming the integrals into series of one and two-dimensional integrals.
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